2-(butan-2-ylamino)ethyl 4-azanyl-2-chloranyl-benzoate; methanoic acid

Systemtic Name: 2-(butan-2-ylamino)ethyl 4-azanyl-2-chloranyl-benzoate; methanoic acid Openeye Name: formic acid; 2-(sec-butylamino)ethyl 4-amino-2-chloro-benzoate CAS Name: 4-amino-2-chlorobenzoic acid 2-(butan-2-ylamino)ethyl ester; formic acid IUPAC Name: 2-(butan-2-ylamino)ethyl 4-amino-2-chlorobenzoate; formic acid Traditional Name: 4-amino-2-chloro-benzoic acid 2-(sec-butylamino)ethyl ester; formic acid Formula: C14H21ClN2O4 MolecularWeight: 316.78054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCOC(=O)C1=C(C=C(C=C1)N)Cl.C(=O)O

Isomeric SMILES

CCC(C)NCCOC(=O)C1=C(C=C(C=C1)N)Cl.C(=O)O

InChI

InChI=1S/C13H19ClN2O2.CH2O2/c1-3-9(2)16-6-7-18-13(17)11-5-4-10(15)8-12(11)14;2-1-3/h4-5,8-9,16H,3,6-7,15H2,1-2H3;1H,(H,2,3)